methyl 7-[2-[2-[(4-methylphenoxy)methyl]-1,3-thiazol-4-yl]ethanoylamino]heptanoate

Systemtic Name: methyl 7-[2-[2-[(4-methylphenoxy)methyl]-1,3-thiazol-4-yl]ethanoylamino]heptanoate Openeye Name: methyl 7-[[2-[2-[(4-methylphenoxy)methyl]thiazol-4-yl]acetyl]amino]heptanoate CAS Name: 7-[[2-[2-[(4-methylphenoxy)methyl]-4-thiazolyl]-1-oxoethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[2-[2-[(4-methylphenoxy)methyl]-1,3-thiazol-4-yl]acetyl]amino]heptanoate Traditional Name: 7-[[2-[2-[(4-methylphenoxy)methyl]thiazol-4-yl]acetyl]amino]enanthic acid methyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)CC(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)CC(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C21H28N2O4S/c1-16-8-10-18(11-9-16)27-14-20-23-17(15-28-20)13-19(24)22-12-6-4-3-5-7-21(25)26-2/h8-11,15H,3-7,12-14H2,1-2H3,(H,22,24)